SCHEMBL8435477

SCHEMBL8435477

CC(O)(O[Si](C)(C)C(C)(C)C)C1CN(Cc2ccccc2)CCC1=O

nearest known ligand 0.46

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
TACR1 P25103 6/20 0.46
GRIN1 Q05586 1/20 0.39
GRIN2B Q13224 1/20 0.39
SIGMAR1 Q99720 1/20 0.39
CHRM3 P20309 1/20 0.37
ALDH1A1 P00352 2/20 0.37
LMNA P02545 1/20 0.37

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL6340896 0.77 TACR1 (0.48) TACR1GRIN1GRIN2BSIGMAR1ALDH1A1
SCHEMBL8804899 0.76 TACR1 (0.47) TACR1GRIN1GRIN2BSIGMAR1ALDH1A1
SCHEMBL8435472 0.76 TACR1 (0.53) TACR1GRIN1GRIN2BSIGMAR1LMNA
SCHEMBL7227226 0.74 TACR1 (0.58) TACR1GRIN1GRIN2BSIGMAR1ALDH1A1
Alcohol SCHEMBL27874245 0.74 TACR1 (0.53) TACR1GRIN1GRIN2BSIGMAR1ALDH1A1
SCHEMBL6042725 0.71 TACR1 (0.49) TACR1GRIN1GRIN2BSIGMAR1
SCHEMBL20722666 0.71 SIGMAR1 (0.47) TACR1SIGMAR1ALDH1A1LMNA
SCHEMBL16836134 0.70 SIGMAR1 (0.64) TACR1GRIN1GRIN2BSIGMAR1ALDH1A1
SCHEMBL6943959 0.70 TACR1 (0.62) TACR1GRIN1GRIN2BSIGMAR1ALDH1A1
SCHEMBL467266 0.70 TACR1 (0.62) TACR1GRIN1GRIN2BSIGMAR1ALDH1A1

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5998433-A THERAPY FOR HYPERLIPIDEMIA; ATHEROSCLEROSIS TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) 1999-12-07 US disclosed